![2-Methyl-3-[(1,3-dithiain-2-yl)propyl]but-2-enolide](/api/spectrum/2VSKUJfQByM/structure.png?h=300&w=458 "2-Methyl-3-[(1,3-dithiain-2-yl)propyl]but-2-enolide")
| SpectraBase Compound ID | 11dFo8nsgRj |
|---|---|
| InChI | InChI=1S/C12H18O2S2/c1-9-10(8-14-12(9)13)4-2-5-11-15-6-3-7-16-11/h11H,2-8H2,1H3 |
| InChIKey | BOEUGVIXVLCJBD-UHFFFAOYSA-N |
| Mol Weight | 258.39 g/mol |
| Molecular Formula | C12H18O2S2 |
| Exact Mass | 258.074822 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2VSKUJfQByM |
|---|---|
| Name | 2-Methyl-3-[(1,3-dithiain-2-yl)propyl]but-2-enolide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H18O2S2 |
| InChI | InChI=1S/C12H18O2S2/c1-9-10(8-14-12(9)13)4-2-5-11-15-6-3-7-16-11/h11H,2-8H2,1H3 |
| InChIKey | BOEUGVIXVLCJBD-UHFFFAOYSA-N |
| Molecular Weight | 258.394 g/mol |
| SMILES | C1(C(=C(CCCC2SCCCS2)CO1)C)=O |
| SPLASH | splash10-0pvl-3910000000-7ed5d51923e2dd9e964a |
| Source of Spectrum | F-50-5492-12c |
| Wiley ID | 1261390 |